N-(2,4-dimethoxyphenyl)-2-{[4-ethyl-5-(2-hydroxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Chemical Structure Depiction of
N-(2,4-dimethoxyphenyl)-2-{[4-ethyl-5-(2-hydroxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
N-(2,4-dimethoxyphenyl)-2-{[4-ethyl-5-(2-hydroxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide
Compound characteristics
| Compound ID: | Y203-0202 |
| Compound Name: | N-(2,4-dimethoxyphenyl)-2-{[4-ethyl-5-(2-hydroxypropan-2-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide |
| Molecular Weight: | 380.46 |
| Molecular Formula: | C17 H24 N4 O4 S |
| Smiles: | CCn1c(C(C)(C)O)nnc1SCC(Nc1ccc(cc1OC)OC)=O |
| Stereo: | ACHIRAL |
| logP: | 1.8866 |
| logD: | 1.8865 |
| logSw: | -2.6041 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 77.583 |
| InChI Key: | HHKGEQBIRJXPIT-UHFFFAOYSA-N |